Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TOP1 | P11387 | 3/20 | 0.44 |
| ▸ | KIF11 | P52732 | 2/20 | 0.43 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.41 |
| ▸ | DYRK2 | Q92630 | 1/20 | 0.41 |
| ▸ | GABBR2 | O75899 | 5/20 | 0.39 |
| ▸ | GABBR1 | Q9UBS5 | 5/20 | 0.39 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.39 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.39 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.38 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.38 |
| ▸ | CDK1 | P06493 | 1/20 | 0.38 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.38 |
| ▸ | GSK3A | P49840 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.38 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.38 |
| ▸ | TOP2A | P11388 | 1/20 | 0.38 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL30603042 | 1.00 | TOP1 (0.44) | TOP1KIF11DYRK1ADYRK2GABBR2 | |
| SCHEMBL26614921 | 1.00 | TOP1 (0.44) | TOP1KIF11DYRK1ADYRK2GABBR2 | |
| SCHEMBL26615070 | 0.92 | TOP1 (0.39) | TOP1KIF11DYRK1ADYRK2GABBR2 | |
| SCHEMBL30602981 | 0.82 | TOP1 (0.50) | TOP1KIF11ENPP1TOP2A | |
| SCHEMBL26614885 | 0.82 | TOP1 (0.50) | TOP1KIF11ENPP1TOP2A | |
| SCHEMBL26627709 | 0.73 | TOP1 (0.39) | TOP1KIF11DYRK1AGABBR2GABBR1 | |
| Hydrochloric Acid SCHEMBL26627622 | 0.72 | TOP1 (0.38) | TOP1KIF11DYRK1AGABBR2GABBR1 | |
| SCHEMBL24393267 | 0.71 | MAP4K4 (0.44) | TOP1KIF11DYRK1ADYRK2S1PR1 | |
| SCHEMBL3322318 | 0.70 | KIF11 (0.50) | KIF11DYRK1ADYRK2S1PR1S1PR3 | |
| SCHEMBL23796227 | 0.70 | TRPV1 (0.43) | TOP1KIF11DYRK1ADYRK2S1PR1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023209090-A1 | BICYCLIC HETEROAROMATIC COMPOUNDS AND THEIR APPLICATION IN THE TREATMENT OF CANCER | ASTRAZENECA AB (SE) | 2023-11-02 | — | — | WO | disclosed |